4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide

C16H24N2O2 — CID 66249430

IUPAC4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide
SMILESCN(CCCc1ccccc1)C(=O)C1(C)COCC1N
InChIInChI=1S/C16H24N2O2/c1-16(12-20-11-14(16)17)15(19)18(2)10-6-9-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12,17H2,1-2H3
InChIKeyRDHVXKQSWKXXLK-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.44
Rot. Bonds5

About 4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide

4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide (PubChem CID 66249430) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide
PubChem CID66249430
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide
SMILESCN(CCCc1ccccc1)C(=O)C1(C)COCC1N
InChIInChI=1S/C16H24N2O2/c1-16(12-20-11-14(16)17)15(19)18(2)10-6-9-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12,17H2,1-2H3
InChIKeyRDHVXKQSWKXXLK-UHFFFAOYSA-N
XLogP1.44
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-benzyl-N-(2-hydroxyethyl)-3-methyloxolane-3-carboxamide
CID 66250442
3-phenylpropyl 4-amino-3-methyloxolane-3-carboxylate
CID 66249748
4-amino-N-benzyl-N-cyclopropyl-3-methyloxolane-3-carboxamide
CID 66250990
4-amino-N-[2-(4-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide
CID 66248870
4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide
CID 66249079
1-amino-N-methyl-N-(4-phenylbutyl)cyclopropane-1-carboxamide
CID 65464465
4-amino-N-[2-(diethylamino)-2-oxoethyl]-N,3-dimethyloxolane-3-carboxamide
CID 66250253
4-amino-N-[2-(dimethylamino)-1-phenylethyl]-3-methyloxolane-3-carboxamide
CID 66250851
4-amino-N-(1-hydroxy-3-phenylpropan-2-yl)-3-methyloxolane-3-carboxamide
CID 66263893
methyl 2-[(4-amino-3-methyloxolane-3-carbonyl)-methylamino]acetate
CID 66250642
3-(hydroxymethyl)-N-methyl-N-(2-phenylethyl)oxetane-3-carboxamide
CID 115185456
2-amino-N-methyl-N-(3-phenylpropyl)acetamide
CID 43588759

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide?
The IUPAC name of 4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide (CID 66249430) is 4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide is CN(CCCc1ccccc1)C(=O)C1(C)COCC1N.
What is the InChIKey of 4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide?
The InChIKey is RDHVXKQSWKXXLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-16(12-20-11-14(16)17)15(19)18(2)10-6-9-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12,17H2,1-2H3.
What are the key properties of 4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide?
4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide is sourced from PubChem (CID 66249430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).